(4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide

C12H7Cl3NO2S- — CID 4744428

IUPAC(4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide
SMILESO=S(=O)([N-]c1ccc(Cl)cc1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C12H7Cl3NO2S/c13-8-1-4-10(5-2-8)16-19(17,18)12-7-9(14)3-6-11(12)15/h1-7H/q-1
InChIKeyZJZZJCLHAFUZDF-UHFFFAOYSA-N
MW335.62 g/mol
LogP5.04
Rot. Bonds3

About (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide

(4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide (PubChem CID 4744428) has the molecular formula C12H7Cl3NO2S- and a molecular weight of 335.62 g/mol. Its IUPAC name is (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide.

Molecular Properties

Compound Name(4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide
PubChem CID4744428
Molecular FormulaC12H7Cl3NO2S-
Molecular Weight335.62 g/mol
Exact Mass333.93
IUPAC Name(4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide
SMILESO=S(=O)([N-]c1ccc(Cl)cc1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C12H7Cl3NO2S/c13-8-1-4-10(5-2-8)16-19(17,18)12-7-9(14)3-6-11(12)15/h1-7H/q-1
InChIKeyZJZZJCLHAFUZDF-UHFFFAOYSA-N
XLogP5.04
TPSA48.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.62
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3-acetylphenyl)-(2,5-dichlorophenyl)sulfonylazanide
CID 4745426
2,5-dichloro-N-(2,5-dichlorophenyl)sulfonylbenzenesulfonamide
CID 121010955
barium(2+);2,5-dichlorobenzenesulfonic acid;hydride
CID 173437131
CID 87064436
CID 87064436
[2-chloro-5-[(4-nitrobenzoyl)amino]phenyl]sulfonyl-(4-chlorophenyl)azanide
CID 26654448
(4-chlorophenyl)sulfonyl-(2,5-dichlorophenyl)azanide
CID 4740400
1-(2,5-dichlorophenyl)sulfonylpyrrolidine-3,4-diol
CID 106672458
1-(2,5-dichlorophenyl)sulfonylpyrrolidine
CID 767694
2,5-dichloro-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]benzenesulfonamide
CID 107848386
propan-2-yl 2,5-dichlorobenzenesulfonate
CID 87077321
sulfuryl dichloride;1,2,4-trichlorobenzene
CID 77134549
2,5-dichloro-N-(3-ethylpent-1-yn-3-yl)benzenesulfonamide
CID 19684142

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide?
The IUPAC name of (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide (CID 4744428) is (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide.
What is the SMILES notation for (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide?
The canonical SMILES for (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide is O=S(=O)([N-]c1ccc(Cl)cc1)c1cc(Cl)ccc1Cl.
What is the InChIKey of (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide?
The InChIKey is ZJZZJCLHAFUZDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl3NO2S/c13-8-1-4-10(5-2-8)16-19(17,18)12-7-9(14)3-6-11(12)15/h1-7H/q-1.
What are the key properties of (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide?
(4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide has a molecular weight of 335.62 g/mol, XLogP of 5.04, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(2,5-dichlorophenyl)sulfonylazanide is sourced from PubChem (CID 4744428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).